[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] (5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] (5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(9H-fluoren-3-yl)-2-oxo-ethyl] (5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: (5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [2-(9H-fluoren-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(9H-fluoren-3-yl)-2-oxoethyl] (5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: (5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid [2-(9H-fluoren-3-yl)-2-keto-ethyl] ester Formula: C25H22O3S MolecularWeight: 402.50538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)OCC(=O)C3=CC4=C(CC5=CC=CC=C54)C=C3

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)OCC(=O)C3=CC4=C(CC5=CC=CC=C54)C=C3

InChI

InChI=1S/C25H22O3S/c1-15-6-9-23-19(10-15)13-24(29-23)25(27)28-14-22(26)18-8-7-17-11-16-4-2-3-5-20(16)21(17)12-18/h2-5,7-8,12-13,15H,6,9-11,14H2,1H3/t15-/m0/s1